CID 5082415

Aziridin-1-yldiphenylphosphine oxide

Structural Information

Molecular Formula

C₁₄H₁₄NOP

SMILES

C1CN1P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C14H14NOP/c16-17(15-11-12-15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2

InChIKey

XBDGFRDNSRXZJZ-UHFFFAOYSA-N

Compound name

1-diphenylphosphorylaziridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 243.0813 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	244.08858	156.6
[M+Na]+	266.07052	164.8
[M-H]-	242.07402	164.0
[M+NH4]+	261.11512	167.8
[M+K]+	282.04446	160.9
[M+H-H2O]+	226.07856	145.9
[M+HCOO]-	288.07950	183.9
[M+CH3COO]-	302.09515	194.7
[M+Na-2H]-	264.05597	161.2
[M]+	243.08075	158.1
[M]-	243.08185	158.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.